4-[[(2-chloranyl-5-nitro-phenyl)amino]methyl]benzene-1,2-diol

Systemtic Name: 4-[[(2-chloranyl-5-nitro-phenyl)amino]methyl]benzene-1,2-diol Openeye Name: 4-[(2-chloro-5-nitro-anilino)methyl]benzene-1,2-diol CAS Name: 4-[(2-chloro-5-nitroanilino)methyl]benzene-1,2-diol IUPAC Name: 4-[(2-chloro-5-nitroanilino)methyl]benzene-1,2-diol Traditional Name: 4-[(2-chloro-5-nitro-anilino)methyl]pyrocatechol Formula: C13H11ClN2O4 MolecularWeight: 294.69044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CNC2=C(C=CC(=C2)[N+](=O)[O-])Cl)O)O

Isomeric SMILES

C1=CC(=C(C=C1CNC2=C(C=CC(=C2)[N+](=O)[O-])Cl)O)O

InChI

InChI=1S/C13H11ClN2O4/c14-10-3-2-9(16(19)20)6-11(10)15-7-8-1-4-12(17)13(18)5-8/h1-6,15,17-18H,7H2